CID 3049932

3',5'-dibromo-2,2'-dihydroxybenzanilide

Structural Information

Molecular Formula
C13H9Br2NO3
SMILES
C1=CC=C(C(=C1)C(=O)NC2=C(C(=CC(=C2)Br)Br)O)O
InChI
InChI=1S/C13H9Br2NO3/c14-7-5-9(15)12(18)10(6-7)16-13(19)8-3-1-2-4-11(8)17/h1-6,17-18H,(H,16,19)
InChIKey
YHYJKLIZEHSLQV-UHFFFAOYSA-N
Compound name
N-(3,5-dibromo-2-hydroxyphenyl)-2-hydroxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

384.89493 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 385.90221 160.6
[M+Na]+ 407.88415 169.7
[M-H]- 383.88765 167.6
[M+NH4]+ 402.92875 175.2
[M+K]+ 423.85809 153.4
[M+H-H2O]+ 367.89219 166.8
[M+HCOO]- 429.89313 174.8
[M+CH3COO]- 443.90878 213.5
[M+Na-2H]- 405.86960 164.8
[M]+ 384.89438 193.0
[M]- 384.89548 193.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.